Registration Dossier

Physical & Chemical properties

Surface tension

Currently viewing:

Administrative data

Link to relevant study record(s)

Reference
Endpoint:
surface tension
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Predicted data from ACD Labs.
Qualifier:
according to guideline
Guideline:
other: as mentioned below
Principles of method if other than guideline:
ACD/I-Lab accepts smiles of test item and predicted data for surface tension using v12.1.0.50375.
GLP compliance:
no
Type of method:
other: no data
Specific details on test material used for the study:
- Name of test material: 3-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexan-1-ol
- IUPAC name: 3-(5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl)cyclohexan-1-ol
- Molecular formula: C16H28O
- Molecular weight: 236.396 g/mole
- Smiles :O[C@@H]1CCC[C@@H]([C@@H]2[C@@H]3C[C@@H](C(C)(C)[C@@H]3C)C2)C1
- Inchl: 1S/C16H28O/c1-10-14-8-12(16(10,2)3)9-15(14)11-5-4-6-13(17)7-11/h10-15,17H,4-9H2,1-3H3
- Substance type: Organic
- Physical state: viscous liquid
Key result
Surface tension:
34.7 other: dyne/cm
Remarks on result:
other: Estimated value = 34.7 ± 3.0 dyne/cm
Conclusions:
Based on the prediction done by ACD labs, the surface tension for test chemical was predicted to be 34.7 ± 3.0 dyne/cm.
Executive summary:

Based on the prediction done by ACD labs, the surface tension for test chemical was predicted to be 34.7 ± 3.0 dyne/cm.

Description of key information

Based on the prediction done by ACD labs, the surface tension for test chemical was predicted to be 34.7 ± 3.0 dyne/cm.

Key value for chemical safety assessment

Surface tension:
34.7

Additional information

Based on the prediction done by ACD labs, the surface tension for test chemical was predicted to be 34.7 ± 3.0 dyne/cm.